Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30830
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 1D . . . 30830 1
2 '2D 1H-1H TOCSY' . . . 30830 1
3 '2D 1H-1H NOESY' . . . 30830 1
4 '2D 1H-13C HSQC' . . . 30830 1
5 '2D 1H-1H TOCSY' . . . 30830 1
6 '2D 1H-1H TOCSY' . . . 30830 1
7 '2D 1H-1H TOCSY' . . . 30830 1
8 '2D 1H-1H TOCSY' . . . 30830 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 GLY H H 1 8.320 0.000 . . . . . A A 1 GLY H1 . 30830 1
2 . 1 . 1 1 1 GLY HA2 H 1 3.752 0.000 . . . . . A A 1 GLY HA2 . 30830 1
3 . 1 . 1 1 1 GLY HA3 H 1 4.119 0.000 . . . . . A A 1 GLY HA3 . 30830 1
4 . 1 . 1 2 2 PHE H H 1 7.835 0.000 . . . . . A A 2 PHE H . 30830 1
5 . 1 . 1 2 2 PHE HA H 1 4.657 0.000 . . . . . A A 2 PHE HA . 30830 1
6 . 1 . 1 2 2 PHE HB2 H 1 3.053 0.000 . . . . . A A 2 PHE HB2 . 30830 1
7 . 1 . 1 2 2 PHE HB3 H 1 2.888 0.000 . . . . . A A 2 PHE HB3 . 30830 1
8 . 1 . 1 2 2 PHE HD1 H 1 7.053 0.000 . . . . . A A 2 PHE HD1 . 30830 1
9 . 1 . 1 2 2 PHE HD2 H 1 7.053 0.000 . . . . . A A 2 PHE HD2 . 30830 1
10 . 1 . 1 2 2 PHE HE1 H 1 7.196 0.000 . . . . . A A 2 PHE HE1 . 30830 1
11 . 1 . 1 2 2 PHE HE2 H 1 7.196 0.000 . . . . . A A 2 PHE HE2 . 30830 1
12 . 1 . 1 2 2 PHE HZ H 1 6.983 0.000 . . . . . A A 2 PHE HZ . 30830 1
13 . 1 . 1 2 2 PHE CA C 13 58.015 0.000 . . . . . A A 2 PHE CA . 30830 1
14 . 1 . 1 2 2 PHE CB C 13 38.736 0.000 . . . . . A A 2 PHE CB . 30830 1
15 . 1 . 1 3 3 CYS H H 1 8.175 0.000 . . . . . A A 3 CYS H . 30830 1
16 . 1 . 1 3 3 CYS HA H 1 5.439 0.000 . . . . . A A 3 CYS HA . 30830 1
17 . 1 . 1 3 3 CYS HB2 H 1 2.911 0.000 . . . . . A A 3 CYS HB2 . 30830 1
18 . 1 . 1 3 3 CYS HB3 H 1 2.584 0.000 . . . . . A A 3 CYS HB3 . 30830 1
19 . 1 . 1 3 3 CYS CA C 13 55.005 0.000 . . . . . A A 3 CYS CA . 30830 1
20 . 1 . 1 4 4 TRP H H 1 9.015 0.000 . . . . . A A 4 TRP H . 30830 1
21 . 1 . 1 4 4 TRP HA H 1 4.597 0.000 . . . . . A A 4 TRP HA . 30830 1
22 . 1 . 1 4 4 TRP HB2 H 1 3.159 0.000 . . . . . A A 4 TRP HB2 . 30830 1
23 . 1 . 1 4 4 TRP HB3 H 1 3.003 0.000 . . . . . A A 4 TRP HB3 . 30830 1
24 . 1 . 1 4 4 TRP HD1 H 1 7.234 0.000 . . . . . A A 4 TRP HD1 . 30830 1
25 . 1 . 1 4 4 TRP HE1 H 1 10.404 0.000 . . . . . A A 4 TRP HE1 . 30830 1
26 . 1 . 1 4 4 TRP HE3 H 1 7.463 0.000 . . . . . A A 4 TRP HE3 . 30830 1
27 . 1 . 1 4 4 TRP HZ2 H 1 7.343 0.000 . . . . . A A 4 TRP HZ2 . 30830 1
28 . 1 . 1 4 4 TRP HZ3 H 1 6.969 0.000 . . . . . A A 4 TRP HZ3 . 30830 1
29 . 1 . 1 4 4 TRP HH2 H 1 6.939 0.000 . . . . . A A 4 TRP HH2 . 30830 1
30 . 1 . 1 4 4 TRP CA C 13 57.224 0.000 . . . . . A A 4 TRP CA . 30830 1
31 . 1 . 1 4 4 TRP CB C 13 31.001 0.000 . . . . . A A 4 TRP CB . 30830 1
32 . 1 . 1 5 5 HIS H H 1 8.999 0.000 . . . . . A A 5 HIS H . 30830 1
33 . 1 . 1 5 5 HIS HA H 1 3.663 0.000 . . . . . A A 5 HIS HA . 30830 1
34 . 1 . 1 5 5 HIS HB2 H 1 3.182 0.000 . . . . . A A 5 HIS HB2 . 30830 1
35 . 1 . 1 5 5 HIS HB3 H 1 3.040 0.000 . . . . . A A 5 HIS HB3 . 30830 1
36 . 1 . 1 5 5 HIS HD2 H 1 5.877 0.000 . . . . . A A 5 HIS HD2 . 30830 1
37 . 1 . 1 5 5 HIS CA C 13 56.783 0.000 . . . . . A A 5 HIS CA . 30830 1
38 . 1 . 1 6 6 HIS H H 1 8.716 0.000 . . . . . A A 6 HIS H . 30830 1
39 . 1 . 1 6 6 HIS HA H 1 4.312 0.000 . . . . . A A 6 HIS HA . 30830 1
40 . 1 . 1 6 6 HIS HB2 H 1 3.506 0.000 . . . . . A A 6 HIS HB2 . 30830 1
41 . 1 . 1 6 6 HIS HB3 H 1 3.407 0.000 . . . . . A A 6 HIS HB3 . 30830 1
42 . 1 . 1 6 6 HIS HD2 H 1 7.165 0.000 . . . . . A A 6 HIS HD2 . 30830 1
43 . 1 . 1 6 6 HIS CA C 13 56.582 0.000 . . . . . A A 6 HIS CA . 30830 1
44 . 1 . 1 6 6 HIS CB C 13 26.897 0.000 . . . . . A A 6 HIS CB . 30830 1
45 . 1 . 1 7 7 SER H H 1 8.170 0.000 . . . . . A A 7 SER H . 30830 1
46 . 1 . 1 7 7 SER HA H 1 4.804 0.000 . . . . . A A 7 SER HA . 30830 1
47 . 1 . 1 7 7 SER HB2 H 1 4.069 0.000 . . . . . A A 7 SER HB2 . 30830 1
48 . 1 . 1 7 7 SER HB3 H 1 3.890 0.000 . . . . . A A 7 SER HB3 . 30830 1
49 . 1 . 1 8 8 CYS H H 1 8.702 0.000 . . . . . A A 8 CYS H . 30830 1
50 . 1 . 1 8 8 CYS HA H 1 5.466 0.000 . . . . . A A 8 CYS HA . 30830 1
51 . 1 . 1 8 8 CYS HB2 H 1 2.823 0.000 . . . . . A A 8 CYS HB2 . 30830 1
52 . 1 . 1 8 8 CYS HB3 H 1 2.823 0.000 . . . . . A A 8 CYS HB3 . 30830 1
53 . 1 . 1 8 8 CYS CA C 13 55.140 0.000 . . . . . A A 8 CYS CA . 30830 1
54 . 1 . 1 8 8 CYS CB C 13 33.870 0.000 . . . . . A A 8 CYS CB . 30830 1
55 . 1 . 1 9 9 VAL H H 1 8.771 0.000 . . . . . A A 9 VAL H . 30830 1
56 . 1 . 1 9 9 VAL HA H 1 4.264 0.000 . . . . . A A 9 VAL HA . 30830 1
57 . 1 . 1 9 9 VAL HB H 1 1.735 0.000 . . . . . A A 9 VAL HB . 30830 1
58 . 1 . 1 9 9 VAL HG11 H 1 0.746 0.000 . . . . . A A 9 VAL HG11 . 30830 1
59 . 1 . 1 9 9 VAL HG12 H 1 0.746 0.000 . . . . . A A 9 VAL HG12 . 30830 1
60 . 1 . 1 9 9 VAL HG13 H 1 0.746 0.000 . . . . . A A 9 VAL HG13 . 30830 1
61 . 1 . 1 9 9 VAL HG21 H 1 0.692 0.000 . . . . . A A 9 VAL HG21 . 30830 1
62 . 1 . 1 9 9 VAL HG22 H 1 0.692 0.000 . . . . . A A 9 VAL HG22 . 30830 1
63 . 1 . 1 9 9 VAL HG23 H 1 0.692 0.000 . . . . . A A 9 VAL HG23 . 30830 1
64 . 1 . 1 9 9 VAL CA C 13 59.266 0.000 . . . . . A A 9 VAL CA . 30830 1
65 . 1 . 1 9 9 VAL CB C 13 32.194 0.000 . . . . . A A 9 VAL CB . 30830 1
66 . 1 . 1 10 10 PRO HA H 1 4.483 0.000 . . . . . A A 10 PRO HA . 30830 1
67 . 1 . 1 10 10 PRO HB2 H 1 2.392 0.000 . . . . . A A 10 PRO HB2 . 30830 1
68 . 1 . 1 10 10 PRO HB3 H 1 2.007 0.000 . . . . . A A 10 PRO HB3 . 30830 1
69 . 1 . 1 10 10 PRO HG2 H 1 2.034 0.000 . . . . . A A 10 PRO HG2 . 30830 1
70 . 1 . 1 10 10 PRO HG3 H 1 1.831 0.000 . . . . . A A 10 PRO HG3 . 30830 1
71 . 1 . 1 10 10 PRO HD2 H 1 3.959 0.000 . . . . . A A 10 PRO HD2 . 30830 1
72 . 1 . 1 10 10 PRO HD3 H 1 3.609 0.000 . . . . . A A 10 PRO HD3 . 30830 1
73 . 1 . 1 10 10 PRO CA C 13 62.285 0.000 . . . . . A A 10 PRO CA . 30830 1
74 . 1 . 1 10 10 PRO CB C 13 32.371 0.000 . . . . . A A 10 PRO CB . 30830 1
75 . 1 . 1 11 11 SER H H 1 8.832 0.000 . . . . . A A 11 SER H . 30830 1
76 . 1 . 1 11 11 SER HA H 1 4.129 0.000 . . . . . A A 11 SER HA . 30830 1
77 . 1 . 1 11 11 SER HB2 H 1 3.903 0.000 . . . . . A A 11 SER HB2 . 30830 1
78 . 1 . 1 11 11 SER HB3 H 1 3.867 0.000 . . . . . A A 11 SER HB3 . 30830 1
79 . 1 . 1 11 11 SER CA C 13 59.651 0.000 . . . . . A A 11 SER CA . 30830 1
80 . 1 . 1 11 11 SER CB C 13 62.836 0.000 . . . . . A A 11 SER CB . 30830 1
81 . 1 . 1 12 12 GLY H H 1 8.685 0.000 . . . . . A A 12 GLY H . 30830 1
82 . 1 . 1 12 12 GLY HA2 H 1 3.715 0.000 . . . . . A A 12 GLY HA2 . 30830 1
83 . 1 . 1 12 12 GLY HA3 H 1 4.377 0.000 . . . . . A A 12 GLY HA3 . 30830 1
84 . 1 . 1 13 13 THR H H 1 8.567 0.000 . . . . . A A 13 THR H . 30830 1
85 . 1 . 1 13 13 THR HA H 1 4.156 0.000 . . . . . A A 13 THR HA . 30830 1
86 . 1 . 1 13 13 THR HB H 1 4.129 0.000 . . . . . A A 13 THR HB . 30830 1
87 . 1 . 1 13 13 THR HG21 H 1 1.238 0.000 . . . . . A A 13 THR HG21 . 30830 1
88 . 1 . 1 13 13 THR HG22 H 1 1.238 0.000 . . . . . A A 13 THR HG22 . 30830 1
89 . 1 . 1 13 13 THR HG23 H 1 1.238 0.000 . . . . . A A 13 THR HG23 . 30830 1
90 . 1 . 1 13 13 THR CA C 13 64.197 0.000 . . . . . A A 13 THR CA . 30830 1
91 . 1 . 1 14 14 CYS H H 1 8.604 0.000 . . . . . A A 14 CYS H . 30830 1
92 . 1 . 1 14 14 CYS HA H 1 5.546 0.000 . . . . . A A 14 CYS HA . 30830 1
93 . 1 . 1 14 14 CYS HB2 H 1 3.076 0.000 . . . . . A A 14 CYS HB2 . 30830 1
94 . 1 . 1 14 14 CYS HB3 H 1 2.354 0.000 . . . . . A A 14 CYS HB3 . 30830 1
95 . 1 . 1 14 14 CYS CA C 13 55.262 0.000 . . . . . A A 14 CYS CA . 30830 1
96 . 1 . 1 15 15 ALA H H 1 8.872 0.000 . . . . . A A 15 ALA H . 30830 1
97 . 1 . 1 15 15 ALA HA H 1 4.423 0.000 . . . . . A A 15 ALA HA . 30830 1
98 . 1 . 1 15 15 ALA HB1 H 1 0.778 0.000 . . . . . A A 15 ALA HB1 . 30830 1
99 . 1 . 1 15 15 ALA HB2 H 1 0.778 0.000 . . . . . A A 15 ALA HB2 . 30830 1
100 . 1 . 1 15 15 ALA HB3 H 1 0.778 0.000 . . . . . A A 15 ALA HB3 . 30830 1
101 . 1 . 1 15 15 ALA CA C 13 50.608 0.000 . . . . . A A 15 ALA CA . 30830 1
102 . 1 . 1 15 15 ALA CB C 13 21.881 0.000 . . . . . A A 15 ALA CB . 30830 1
103 . 1 . 1 16 16 ASP H H 1 8.767 0.000 . . . . . A A 16 ASP H . 30830 1
104 . 1 . 1 16 16 ASP HA H 1 4.810 0.000 . . . . . A A 16 ASP HA . 30830 1
105 . 1 . 1 16 16 ASP HB2 H 1 2.855 0.000 . . . . . A A 16 ASP HB2 . 30830 1
106 . 1 . 1 16 16 ASP HB3 H 1 2.743 0.000 . . . . . A A 16 ASP HB3 . 30830 1
107 . 1 . 1 16 16 ASP CB C 13 37.309 0.000 . . . . . A A 16 ASP CB . 30830 1
108 . 1 . 1 17 17 PHE H H 1 7.604 0.000 . . . . . A A 17 PHE H . 30830 1
109 . 1 . 1 17 17 PHE HA H 1 4.564 0.000 . . . . . A A 17 PHE HA . 30830 1
110 . 1 . 1 17 17 PHE HB2 H 1 3.513 0.000 . . . . . A A 17 PHE HB2 . 30830 1
111 . 1 . 1 17 17 PHE HB3 H 1 2.947 0.000 . . . . . A A 17 PHE HB3 . 30830 1
112 . 1 . 1 17 17 PHE HD1 H 1 7.305 0.000 . . . . . A A 17 PHE HD1 . 30830 1
113 . 1 . 1 17 17 PHE HD2 H 1 7.305 0.000 . . . . . A A 17 PHE HD2 . 30830 1
114 . 1 . 1 17 17 PHE HE1 H 1 7.146 0.000 . . . . . A A 17 PHE HE1 . 30830 1
115 . 1 . 1 17 17 PHE HE2 H 1 7.146 0.000 . . . . . A A 17 PHE HE2 . 30830 1
116 . 1 . 1 17 17 PHE HZ H 1 7.072 0.000 . . . . . A A 17 PHE HZ . 30830 1
117 . 1 . 1 17 17 PHE CA C 13 56.776 0.000 . . . . . A A 17 PHE CA . 30830 1
118 . 1 . 1 18 18 PRO HA H 1 4.643 0.000 . . . . . A A 18 PRO HA . 30830 1
119 . 1 . 1 18 18 PRO HB2 H 1 2.638 0.000 . . . . . A A 18 PRO HB2 . 30830 1
120 . 1 . 1 18 18 PRO HB3 H 1 2.018 0.000 . . . . . A A 18 PRO HB3 . 30830 1
121 . 1 . 1 18 18 PRO HG2 H 1 2.195 0.000 . . . . . A A 18 PRO HG2 . 30830 1
122 . 1 . 1 18 18 PRO HG3 H 1 2.112 0.000 . . . . . A A 18 PRO HG3 . 30830 1
123 . 1 . 1 18 18 PRO HD2 H 1 4.000 0.000 . . . . . A A 18 PRO HD2 . 30830 1
124 . 1 . 1 18 18 PRO HD3 H 1 3.613 0.000 . . . . . A A 18 PRO HD3 . 30830 1
125 . 1 . 1 18 18 PRO CA C 13 62.116 0.000 . . . . . A A 18 PRO CA . 30830 1
126 . 1 . 1 18 18 PRO CB C 13 31.733 0.000 . . . . . A A 18 PRO CB . 30830 1
127 . 1 . 1 19 19 TRP H H 1 9.005 0.000 . . . . . A A 19 TRP H . 30830 1
128 . 1 . 1 19 19 TRP HA H 1 4.192 0.000 . . . . . A A 19 TRP HA . 30830 1
129 . 1 . 1 19 19 TRP HB2 H 1 3.435 0.000 . . . . . A A 19 TRP HB2 . 30830 1
130 . 1 . 1 19 19 TRP HB3 H 1 3.287 0.000 . . . . . A A 19 TRP HB3 . 30830 1
131 . 1 . 1 19 19 TRP HD1 H 1 7.439 0.000 . . . . . A A 19 TRP HD1 . 30830 1
132 . 1 . 1 19 19 TRP HE1 H 1 10.917 0.000 . . . . . A A 19 TRP HE1 . 30830 1
133 . 1 . 1 19 19 TRP HE3 H 1 7.464 0.000 . . . . . A A 19 TRP HE3 . 30830 1
134 . 1 . 1 19 19 TRP HZ2 H 1 7.584 0.000 . . . . . A A 19 TRP HZ2 . 30830 1
135 . 1 . 1 19 19 TRP HZ3 H 1 6.949 0.000 . . . . . A A 19 TRP HZ3 . 30830 1
136 . 1 . 1 19 19 TRP HH2 H 1 7.133 0.000 . . . . . A A 19 TRP HH2 . 30830 1
137 . 1 . 1 19 19 TRP CA C 13 57.489 0.000 . . . . . A A 19 TRP CA . 30830 1
138 . 1 . 1 20 20 PRO HA H 1 3.157 0.000 . . . . . A A 20 PRO HA . 30830 1
139 . 1 . 1 20 20 PRO HB2 H 1 1.469 0.000 . . . . . A A 20 PRO HB2 . 30830 1
140 . 1 . 1 20 20 PRO HB3 H 1 -0.151 0.000 . . . . . A A 20 PRO HB3 . 30830 1
141 . 1 . 1 20 20 PRO HG2 H 1 1.049 0.000 . . . . . A A 20 PRO HG2 . 30830 1
142 . 1 . 1 20 20 PRO HD2 H 1 3.136 0.000 . . . . . A A 20 PRO HD2 . 30830 1
143 . 1 . 1 20 20 PRO HD3 H 1 3.085 0.000 . . . . . A A 20 PRO HD3 . 30830 1
144 . 1 . 1 20 20 PRO CA C 13 62.051 0.000 . . . . . A A 20 PRO CA . 30830 1
145 . 1 . 1 21 21 LEU H H 1 8.228 0.000 . . . . . A A 21 LEU H . 30830 1
146 . 1 . 1 21 21 LEU HA H 1 4.014 0.000 . . . . . A A 21 LEU HA . 30830 1
147 . 1 . 1 21 21 LEU HB2 H 1 1.722 0.000 . . . . . A A 21 LEU HB2 . 30830 1
148 . 1 . 1 21 21 LEU HB3 H 1 1.389 0.000 . . . . . A A 21 LEU HB3 . 30830 1
149 . 1 . 1 21 21 LEU HG H 1 1.018 0.000 . . . . . A A 21 LEU HG . 30830 1
150 . 1 . 1 21 21 LEU HD11 H 1 0.580 0.000 . . . . . A A 21 LEU HD11 . 30830 1
151 . 1 . 1 21 21 LEU HD12 H 1 0.580 0.000 . . . . . A A 21 LEU HD12 . 30830 1
152 . 1 . 1 21 21 LEU HD13 H 1 0.580 0.000 . . . . . A A 21 LEU HD13 . 30830 1
153 . 1 . 1 21 21 LEU HD21 H 1 0.448 0.000 . . . . . A A 21 LEU HD21 . 30830 1
154 . 1 . 1 21 21 LEU HD22 H 1 0.448 0.000 . . . . . A A 21 LEU HD22 . 30830 1
155 . 1 . 1 21 21 LEU HD23 H 1 0.448 0.000 . . . . . A A 21 LEU HD23 . 30830 1
156 . 1 . 1 21 21 LEU CA C 13 57.140 0.000 . . . . . A A 21 LEU CA . 30830 1
157 . 1 . 1 21 21 LEU CB C 13 42.657 0.000 . . . . . A A 21 LEU CB . 30830 1
158 . 1 . 1 22 22 GLY H H 1 6.872 0.000 . . . . . A A 22 GLY H . 30830 1
159 . 1 . 1 22 22 GLY HA2 H 1 3.977 0.000 . . . . . A A 22 GLY HA2 . 30830 1
160 . 1 . 1 22 22 GLY HA3 H 1 3.848 0.000 . . . . . A A 22 GLY HA3 . 30830 1
161 . 1 . 1 22 22 GLY CA C 13 45.393 0.003 . . . . . A A 22 GLY CA . 30830 1
162 . 1 . 1 23 23 HIS H H 1 8.544 0.000 . . . . . A A 23 HIS H . 30830 1
163 . 1 . 1 23 23 HIS HA H 1 5.131 0.000 . . . . . A A 23 HIS HA . 30830 1
164 . 1 . 1 23 23 HIS HB2 H 1 3.219 0.000 . . . . . A A 23 HIS HB2 . 30830 1
165 . 1 . 1 23 23 HIS HB3 H 1 3.173 0.000 . . . . . A A 23 HIS HB3 . 30830 1
166 . 1 . 1 23 23 HIS HD2 H 1 7.252 0.000 . . . . . A A 23 HIS HD2 . 30830 1
167 . 1 . 1 23 23 HIS HE1 H 1 8.600 0.000 . . . . . A A 23 HIS HE1 . 30830 1
168 . 1 . 1 23 23 HIS CA C 13 56.480 0.000 . . . . . A A 23 HIS CA . 30830 1
169 . 1 . 1 23 23 HIS CB C 13 28.008 0.000 . . . . . A A 23 HIS CB . 30830 1
170 . 1 . 1 24 24 GLN H H 1 8.661 0.000 . . . . . A A 24 GLN H . 30830 1
171 . 1 . 1 24 24 GLN HA H 1 4.547 0.000 . . . . . A A 24 GLN HA . 30830 1
172 . 1 . 1 24 24 GLN HB2 H 1 1.633 0.000 . . . . . A A 24 GLN HB2 . 30830 1
173 . 1 . 1 24 24 GLN HB3 H 1 2.010 0.000 . . . . . A A 24 GLN HB3 . 30830 1
174 . 1 . 1 24 24 GLN HG2 H 1 2.405 0.000 . . . . . A A 24 GLN HG2 . 30830 1
175 . 1 . 1 24 24 GLN HG3 H 1 1.822 0.000 . . . . . A A 24 GLN HG3 . 30830 1
176 . 1 . 1 24 24 GLN HE21 H 1 7.495 0.000 . . . . . A A 24 GLN HE21 . 30830 1
177 . 1 . 1 24 24 GLN HE22 H 1 6.694 0.000 . . . . . A A 24 GLN HE22 . 30830 1
178 . 1 . 1 24 24 GLN CA C 13 53.664 0.000 . . . . . A A 24 GLN CA . 30830 1
179 . 1 . 1 24 24 GLN CB C 13 26.836 0.000 . . . . . A A 24 GLN CB . 30830 1
180 . 1 . 1 25 25 CYS H H 1 8.426 0.000 . . . . . A A 25 CYS H . 30830 1
181 . 1 . 1 25 25 CYS HA H 1 5.266 0.000 . . . . . A A 25 CYS HA . 30830 1
182 . 1 . 1 25 25 CYS HB2 H 1 2.796 0.000 . . . . . A A 25 CYS HB2 . 30830 1
183 . 1 . 1 25 25 CYS HB3 H 1 2.772 0.000 . . . . . A A 25 CYS HB3 . 30830 1
184 . 1 . 1 25 25 CYS CB C 13 47.491 0.000 . . . . . A A 25 CYS CB . 30830 1
185 . 1 . 1 26 26 PHE H H 1 8.610 0.000 . . . . . A A 26 PHE H . 30830 1
186 . 1 . 1 26 26 PHE HA H 1 4.790 0.000 . . . . . A A 26 PHE HA . 30830 1
187 . 1 . 1 26 26 PHE HB2 H 1 3.076 0.000 . . . . . A A 26 PHE HB2 . 30830 1
188 . 1 . 1 26 26 PHE HB3 H 1 3.012 0.000 . . . . . A A 26 PHE HB3 . 30830 1
189 . 1 . 1 26 26 PHE HD1 H 1 7.192 0.000 . . . . . A A 26 PHE HD1 . 30830 1
190 . 1 . 1 26 26 PHE HD2 H 1 7.192 0.000 . . . . . A A 26 PHE HD2 . 30830 1
191 . 1 . 1 26 26 PHE HE1 H 1 7.052 0.000 . . . . . A A 26 PHE HE1 . 30830 1
192 . 1 . 1 26 26 PHE HE2 H 1 7.052 0.000 . . . . . A A 26 PHE HE2 . 30830 1
193 . 1 . 1 26 26 PHE HZ H 1 6.975 0.000 . . . . . A A 26 PHE HZ . 30830 1
194 . 1 . 1 27 27 PRO HA H 1 4.377 0.000 . . . . . A A 27 PRO HA . 30830 1
195 . 1 . 1 27 27 PRO HB2 H 1 2.398 0.000 . . . . . A A 27 PRO HB2 . 30830 1
196 . 1 . 1 27 27 PRO HB3 H 1 1.994 0.000 . . . . . A A 27 PRO HB3 . 30830 1
197 . 1 . 1 27 27 PRO HG2 H 1 2.058 0.000 . . . . . A A 27 PRO HG2 . 30830 1
198 . 1 . 1 27 27 PRO HG3 H 1 2.037 0.000 . . . . . A A 27 PRO HG3 . 30830 1
199 . 1 . 1 27 27 PRO HD2 H 1 3.651 0.000 . . . . . A A 27 PRO HD2 . 30830 1
200 . 1 . 1 27 27 PRO HD3 H 1 3.733 0.000 . . . . . A A 27 PRO HD3 . 30830 1
201 . 1 . 1 27 27 PRO CA C 13 64.010 0.000 . . . . . A A 27 PRO CA . 30830 1
202 . 1 . 1 27 27 PRO CB C 13 31.806 0.006 . . . . . A A 27 PRO CB . 30830 1
203 . 1 . 1 27 27 PRO CD C 13 50.296 0.000 . . . . . A A 27 PRO CD . 30830 1
204 . 1 . 1 28 28 ASP H H 1 8.717 0.000 . . . . . A A 28 ASP H . 30830 1
205 . 1 . 1 28 28 ASP HA H 1 5.012 0.000 . . . . . A A 28 ASP HA . 30830 1
206 . 1 . 1 28 28 ASP HB2 H 1 3.035 0.000 . . . . . A A 28 ASP HB2 . 30830 1
207 . 1 . 1 28 28 ASP HB3 H 1 2.854 0.000 . . . . . A A 28 ASP HB3 . 30830 1
stop_
save_